Information card for entry 7005449

Structure parameters

• Formula: C56 H69 Er2 N22 O19.5 Ru3
• Calculated formula: C56 H44 Er2 N22 O19.5 Ru3
• Title of publication: Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties
• Authors of publication: Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.
• Journal of publication: Dalton Transactions
• Year of publication: 2007
• Journal issue: 23
• Pages of publication: 2419
• a: 15.55 ± 0.003 Å
• b: 15.8 ± 0.003 Å
• c: 17.72 ± 0.004 Å
• α: 111.07 ± 0.03°
• β: 95.38 ± 0.03°
• γ: 95.64 ± 0.03°
• Cell volume: 4003.6 ± 1.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1123
• Residual factor for significantly intense reflections: 0.0828
• Weighted residual factors for significantly intense reflections: 0.1755
• Weighted residual factors for all reflections included in the refinement: 0.1901
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No